Geometry & MOs

Info

ID:	177792
PubChem CID:	76230886
Reduced:	SN3O5C17H17 (1)
Stoich.:	AB3C5D17E17 (1)
Weight, g/mol:	443.04946
ΔH_f, kcal/mol:	-106.32
Dipole, Da:	7.46
IP(EA), eV:	-9.23(-1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2-iodophenyl)methylideneamino]-2,5-dimethyl-1-phenylpyrrole-3-carboxamide

Drug info:

PubChemData

Smile

CC(=NNC(=O)C1COC2=CC=CC=C2O1)C3=CC=C(C=C3)S(=O)(=O)N

DOS

IR

Vibrations